2-[(4-fluoranyl-3-piperidin-1-ylsulfonyl-phenyl)carbonylamino]ethanoic acid

Systemtic Name: 2-[(4-fluoranyl-3-piperidin-1-ylsulfonyl-phenyl)carbonylamino]ethanoic acid Openeye Name: 2-[[4-fluoro-3-(1-piperidylsulfonyl)benzoyl]amino]acetic acid CAS Name: 2-[[[4-fluoro-3-(1-piperidinylsulfonyl)phenyl]-oxomethyl]amino]acetic acid IUPAC Name: 2-[(4-fluoro-3-piperidin-1-ylsulfonylbenzoyl)amino]acetic acid Traditional Name: 2-[(4-fluoro-3-piperidinosulfonyl-benzoyl)amino]acetic acid Formula: C14H17FN2O5S MolecularWeight: 344.358583

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)S(=O)(=O)C2=C(C=CC(=C2)C(=O)NCC(=O)O)F

Isomeric SMILES

C1CCN(CC1)S(=O)(=O)C2=C(C=CC(=C2)C(=O)NCC(=O)O)F

InChI

InChI=1S/C14H17FN2O5S/c15-11-5-4-10(14(20)16-9-13(18)19)8-12(11)23(21,22)17-6-2-1-3-7-17/h4-5,8H,1-3,6-7,9H2,(H,16,20)(H,18,19)